Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H44N10O12 |
Molecular Weight | 700.6981 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 15 / 15 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]2(O[C@H]1[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]1NC(N)=N)O[C@@H](C)[C@](O)(C=NNC(=O)C3=CC=NC=C3)[C@H]2O[C@]4([H])O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4NC
InChI
InChIKey=JCBKYEIGGFKWPQ-HKWRBIJSSA-N
InChI=1S/C27H44N10O12/c1-9-27(45,8-34-37-22(44)10-3-5-33-6-4-10)21(49-23-14(32-2)18(42)15(39)11(7-38)47-23)24(46-9)48-20-13(36-26(30)31)16(40)12(35-25(28)29)17(41)19(20)43/h3-6,8-9,11-21,23-24,32,38-43,45H,7H2,1-2H3,(H,37,44)(H4,28,29,35)(H4,30,31,36)/b34-8+/t9-,11-,12+,13-,14-,15-,16+,17-,18-,19+,20+,21-,23-,24-,27+/m0/s1
Molecular Formula | C27H44N10O12 |
Molecular Weight | 700.6981 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 15 / 15 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:28:13 GMT 2023
by
admin
on
Fri Dec 15 18:28:13 GMT 2023
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Record UNII |
IAB9JFQ8U2
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C280
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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Code System | Code | Type | Description | ||
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77675
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SUB10657MIG
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IAB9JFQ8U2
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DTXSID001017016
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admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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CHEMBL2110590
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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C152437
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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286
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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4480-58-4
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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91617807
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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100000083484
Created by
admin on Fri Dec 15 18:28:13 GMT 2023 , Edited by admin on Fri Dec 15 18:28:13 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT |
Related Record | Type | Details | ||
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ACTIVE MOIETY |